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4-(4-Chloro-phenylamino)-thieno[3,2-c]pyridine-6-carboxylic acid ethyl ester
SpectraBase Compound ID FiFzqJ9yzs7
InChI InChI=1S/C16H13ClN2O2S/c1-2-21-16(20)13-9-14-12(7-8-22-14)15(19-13)18-11-5-3-10(17)4-6-11/h3-9H,2H2,1H3,(H,18,19)
InChIKey BCNGLRXTDKCXDH-UHFFFAOYSA-N
Mol Weight 332.81 g/mol
Molecular Formula C16H13ClN2O2S
Exact Mass 332.038627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 104FyYcLASX
Name 4-(4-Chloro-phenylamino)-thieno[3,2-c]pyridine-6-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 1-[N-(4-Chlorophenyl)amino]thieno[3,2-c]pyridine-3-carboxylate Ethyl 4-(4-chloroanilino)thieno[3,2-c]pyridine-6-carboxylate
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Formula C16H13ClN2O2S
InChI InChI=1S/C16H13ClN2O2S/c1-2-21-16(20)13-9-14-12(7-8-22-14)15(19-13)18-11-5-3-10(17)4-6-11/h3-9H,2H2,1H3,(H,18,19)
InChIKey BCNGLRXTDKCXDH-UHFFFAOYSA-N
Molecular Weight 332.805 g/mol
SMILES N(c1c2c(scc2)cc(n1)C(=O)OCC)c1ccc(cc1)Cl
SPLASH splash10-001i-0049000000-da59ce3833d10ce28461
Source of Spectrum SO-0-47-4
Wiley ID 1539164